3-[2-[[3-methyl-2-[(2-oxidanyl-3-phenyl-propanoyl)amino]butanoyl]amino]propanoylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 3-[2-[[3-methyl-2-[(2-oxidanyl-3-phenyl-propanoyl)amino]butanoyl]amino]propanoylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 3-[2-[[2-[(2-hydroxy-3-phenyl-propanoyl)amino]-3-methyl-butanoyl]amino]propanoylamino]-5-oxo-pentanoic acid CAS Name: 3-[[2-[[2-[(2-hydroxy-1-oxo-3-phenylpropyl)amino]-3-methyl-1-oxobutyl]amino]-1-oxopropyl]amino]-5-oxopentanoic acid IUPAC Name: 3-[2-[[2-[(2-hydroxy-3-phenylpropanoyl)amino]-3-methylbutanoyl]amino]propanoylamino]-5-oxopentanoic acid Traditional Name: 3-[2-[[2-[(2-hydroxy-3-phenyl-propanoyl)amino]-3-methyl-butanoyl]amino]propanoylamino]-5-keto-valeric acid Formula: C22H31N3O7 MolecularWeight: 449.49744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(C)C(=O)NC(CC=O)CC(=O)O)NC(=O)C(CC1=CC=CC=C1)O

Isomeric SMILES

CC(C)C(C(=O)NC(C)C(=O)NC(CC=O)CC(=O)O)NC(=O)C(CC1=CC=CC=C1)O

InChI

InChI=1S/C22H31N3O7/c1-13(2)19(25-21(31)17(27)11-15-7-5-4-6-8-15)22(32)23-14(3)20(30)24-16(9-10-26)12-18(28)29/h4-8,10,13-14,16-17,19,27H,9,11-12H2,1-3H3,(H,23,32)(H,24,30)(H,25,31)(H,28,29)